# Fileset [phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/c2cbd74b-7791-474c-8432-5d8c14e30eed/download) ## Creator [Atsushi Togo](https://orcid.org/0000-0001-8393-9766) ## Rights Creative Commons Attribution 4.0 International[Creative Commons BY Attribution 4.0 International](https://creativecommons.org/licenses/by/4.0/) ## Other metadata [Ab-initio phonon calculation for Ba4TiP4 / P-43n (218) / materials id 15502](https://mdr.nims.go.jp/datasets/2dc6787c-df74-42e5-956b-d0081f283e62) ## Fulltext phonopy: version: 2.17.1 frequency_unit_conversion_factor: 15.633302 symmetry_tolerance: 1.00000e-05 configuration: save_params: ".true."physical_unit: atomic_mass: "AMU" length: "angstrom" force_constants: "eV/angstrom^2"space_group: type: "P-43n" number: 218 Hall_symbol: "P -4n 2 3"supercell_matrix:- [ 1, 0, 0 ]- [ 0, 1, 0 ]- [ 0, 0, 1 ]primitive_cell: lattice: - [ 13.091470950000000, 0.000000000000000, 0.000000000000000 ] # a - [ 0.000000000000000, 13.091470950000000, 0.000000000000000 ] # b - 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